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5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene
TL;DR: 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene (CAS 187-98-4) is a chemical compound with molecular formula C28H16 and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptacyclo[8.6.6.62,9.03,8.011,16.017,22.023,28]octacosa-1,3,5,7,9,11,13,15,17,19,21,23,25,27-tetradecaene
Also Known As: Tetrahydrodianthracene, 9,10[9',10']-Anthracenoanthracene, 9,9',10,10'-Tetradehydrodianthracene, 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene, 5,12:6,11-Di[1,2]benzenodibenzo[a,e]cyclooctene
| Molecular Formula | C28H16 |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 352.1252 |
| Heavy Atoms | 28 |
| Complexity | 544.0 |
Chemical Identifiers
| CAS Number | 187-98-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C5=CC=CC=C5C(=C2C6=CC=CC=C63)C7=CC=CC=C74 |
| InChIKey | HHVDKVOPKKKJCU-UHFFFAOYSA-N |
Product Overview
5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene (CAS 187-98-4), with molecular formula C28H16 and molecular weight 352.13 g/mol. IUPAC: heptacyclo[8.6.6.62,9.03,8.011,16.017,22.023,28]octacosa-1,3,5,7,9,11,13,15,17,19,21,23,25,27-tetradecaene.
Chemical Property Profile of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene
Property Insights of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene
The XLogP value of 5.7 indicates that 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene?
The CAS number of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene is 187-98-4.
What is the molecular formula of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene?
The molecular formula of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene is C28H16.
What is the molecular weight of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene?
The molecular weight of 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene is 352.13 g/mol.
Where can I buy 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene?
You can request a quote for 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene?
Yes, KEHONG BIO provides custom synthesis services for 5,12:6,11-Di-o-benzenodibenzo[a,e]cyclooctene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.